Internal CCS
correction
AcCa, [M+H]
Number of lipids: 1
No correction possible.
AcCa, [M-H]
Number of lipids: 1
No correction possible.
Cer, [M+H]
Number of lipids: 12
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 220
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.18% +/- 0.19%
Internal CCS correction (all correction functions): Mean bias = 0.06%
+/- 0.53%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 495
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.18% +/- 0.19%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.45%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 792
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.18% +/- 0.19%
Internal CCS correction (all correction functions): Mean bias = 0.06%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 924
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.18% +/- 0.19%
Internal CCS correction (all correction functions): Mean bias = 0.08%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

CCS bias: All
correction functions

Cer, [M+Na]
Number of lipids: 12
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 220
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.2% +/- 0.25%
Internal CCS correction (all correction functions): Mean bias = 0.03%
+/- 0.64%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 495
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.2% +/- 0.25%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.44%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 792
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.2% +/- 0.25%
Internal CCS correction (all correction functions): Mean bias = -0.01%
+/- 0.42%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 924
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.2% +/- 0.25%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

CCS bias: All
correction functions

Cer, [M+HCOO]
Number of lipids: 11
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 165
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.84% +/- 0.22%
Internal CCS correction (all correction functions): Mean bias = 0% +/-
0.56%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 330
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.84% +/- 0.22%
Internal CCS correction (all correction functions): Mean bias = 0% +/-
0.49%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 462
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.84% +/- 0.22%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.42%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 462
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.84% +/- 0.22%
Internal CCS correction (all correction functions): Mean bias = 0.02%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

CCS bias: All
correction functions

Co, [M+NH4]
Number of lipids: 1
No correction possible.
Co, [M+Na]
Number of lipids: 1
No correction possible.
DG, [M+NH4]
Number of lipids: 18
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 816
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.64% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.06%
+/- 0.45%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 3060
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.64% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.41%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 8568
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.64% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.09%
+/- 0.37%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 18564
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.64% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.36%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

CCS bias: All
correction functions

DG, [M+Na]
Number of lipids: 18
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 816
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.54% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.02%
+/- 0.4%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 3060
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.54% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 8568
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.54% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.02%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 18564
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.54% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.35%
CCS bias for each correction fuction:
Violin plot - CCS
bias: No CCS correction vs. internal CCS correction

Violin plot - CCS
bias distribution for each internal CCS correction function

CCS bias: All
correction functions

HexCer, [M+H]
Number of lipids: 3
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.12%
Internal CCS correction (all correction functions): Mean bias = -0.33%
+/- 0.11%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

HexCer, [M+Na]
Number of lipids: 3
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.11% +/- 0.05%
Internal CCS correction (all correction functions): Mean bias = 0.18%
+/- 0.04%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

HexCer,
[M+HCOO]
Number of lipids: 4
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 4
Numbers of iterations for resampling: 4
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.45% +/- 0.06%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.36%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.45% +/- 0.06%
Internal CCS correction (all correction functions): Mean bias = -0.08%
+/- 0.05%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

LPC, [M+H]
Number of lipids: 6
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 20
Numbers of iterations for resampling: 20
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.53% +/- 0.32%
Internal CCS correction (all correction functions): Mean bias = -0.04%
+/- 0.36%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 15
Numbers of iterations for resampling: 15
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.53% +/- 0.32%
Internal CCS correction (all correction functions): Mean bias = -0.19%
+/- 0.25%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 6
Numbers of iterations for resampling: 6
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.53% +/- 0.32%
Internal CCS correction (all correction functions): Mean bias = -0.15%
+/- 0.23%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.53% +/- 0.32%
Internal CCS correction (all correction functions): Mean bias = -0.17%
+/- 0.11%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

LPC, [M+HCOO]
Number of lipids: 3
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = -0.07% +/- 0.06%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.05%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

LPC, [M+Na]
Number of lipids: 2
No correction possible.
LPE, [M-H]
Number of lipids: 2
No correction possible.
LPE, [M+H]
Number of lipids: 1
No correction possible.
PA, [M+NH4]
Number of lipids: 9
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 84
Numbers of iterations for resampling: 84
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.61% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.46%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 126
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.61% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = 0.06%
+/- 0.43%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 126
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.61% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = 0.05%
+/- 0.41%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 84
Numbers of iterations for resampling: 84
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.61% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = 0.06%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PA, [M+Na]
Number of lipids: 4
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 4
Numbers of iterations for resampling: 4
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.73% +/- 0.26%
Internal CCS correction (all correction functions): Mean bias = 0.11%
+/- 0.48%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.73% +/- 0.26%
Internal CCS correction (all correction functions): Mean bias = 0.34%
+/- 0.2%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PA, [M-H]
Number of lipids: 9
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 84
Numbers of iterations for resampling: 84
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.07%
+/- 0.37%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 126
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.06%
+/- 0.32%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 126
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.32%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 84
Numbers of iterations for resampling: 84
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.33%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PC, [M+H]
Number of lipids: 35
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 6545
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.21%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.73%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 52360
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.21%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 324632
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.21%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 1623160
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.21%
Internal CCS correction (all correction functions): Mean bias = 0% +/-
0.35%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PC, [M+Na]
Number of lipids: 28
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 3276
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.2%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.41%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 20475
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.2%
Internal CCS correction (all correction functions): Mean bias = -0.01%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 98280
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.2%
Internal CCS correction (all correction functions): Mean bias = 0.07%
+/- 0.36%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 376740
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.82% +/- 0.2%
Internal CCS correction (all correction functions): Mean bias = -0.04%
+/- 0.36%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PC, [M+HCOO]
Number of lipids: 26
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 2600
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.44%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 14950
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.01%
+/- 0.33%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 65780
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.34%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 230230
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.19% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.32%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PE, [M+H]
Number of lipids: 20
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 1140
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.6% +/- 0.28%
Internal CCS correction (all correction functions): Mean bias = -0.07%
+/- 0.59%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 4845
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.6% +/- 0.28%
Internal CCS correction (all correction functions): Mean bias = 0.03%
+/- 0.43%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 15504
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.6% +/- 0.28%
Internal CCS correction (all correction functions): Mean bias = 0.02%
+/- 0.4%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 38760
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.6% +/- 0.28%
Internal CCS correction (all correction functions): Mean bias = -0.01%
+/- 0.4%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PE, [M+Na]
Number of lipids: 14
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 364
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.78% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.73%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 1001
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.78% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.43%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 2002
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.78% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.4%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 3003
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.78% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = 0.02%
+/- 0.4%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PE, [M-H]
Number of lipids: 19
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 969
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.26% +/- 0.16%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 3876
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.26% +/- 0.16%
Internal CCS correction (all correction functions): Mean bias = -0.06%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 11628
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.26% +/- 0.16%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.33%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 27132
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.26% +/- 0.16%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.35%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PG, [M+NH4]
Number of lipids: 2
No correction possible.
PG, [M-H]
Number of lipids: 2
No correction possible.
PI, [M+NH4]
Number of lipids: 4
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 4
Numbers of iterations for resampling: 4
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.65% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.21%
+/- 0.25%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.65% +/- 0.18%
Internal CCS correction (all correction functions): Mean bias = -0.3%
+/- 0.16%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PI, [M+Na]
Number of lipids: 2
No correction possible.
PI, [M-H]
Number of lipids: 5
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 10
Numbers of iterations for resampling: 10
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.35% +/- 0.12%
Internal CCS correction (all correction functions): Mean bias = 0% +/-
0.34%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 5
Numbers of iterations for resampling: 5
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.35% +/- 0.12%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.35% +/- 0.12%
Internal CCS correction (all correction functions): Mean bias = 0.27%
+/- 0.08%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PS, [M+H]
Number of lipids: 6
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 20
Numbers of iterations for resampling: 20
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.74% +/- 0.33%
Internal CCS correction (all correction functions): Mean bias = 0.02%
+/- 0.35%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 15
Numbers of iterations for resampling: 15
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.74% +/- 0.33%
Internal CCS correction (all correction functions): Mean bias = 0.11%
+/- 0.4%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 6
Numbers of iterations for resampling: 6
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.74% +/- 0.33%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.32%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.74% +/- 0.33%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.19%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PS, [M+Na]
Number of lipids: 6
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 20
Numbers of iterations for resampling: 20
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.03% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = 0.03%
+/- 0.59%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 15
Numbers of iterations for resampling: 15
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.03% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = 0.04%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 6
Numbers of iterations for resampling: 6
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.03% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.45%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 1
Numbers of iterations for resampling: 1
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 1.03% +/- 0.36%
Internal CCS correction (all correction functions): Mean bias = 0.47%
+/- 0.3%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

PS, [M-H]
Number of lipids: 8
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 56
Numbers of iterations for resampling: 56
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.33% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = -0.09%
+/- 0.53%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 70
Numbers of iterations for resampling: 70
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.33% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.4%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 56
Numbers of iterations for resampling: 56
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.33% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = 0.05%
+/- 0.35%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 28
Numbers of iterations for resampling: 28
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.33% +/- 0.24%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.38%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

SPH, [M+H]
Number of lipids: 2
No correction possible.
TG, [M+NH4]
Number of lipids: 32
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 4960
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.83% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.02%
+/- 0.32%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 35960
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.83% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = 0.06%
+/- 0.35%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 201376
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.83% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.01%
+/- 0.36%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 906192
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.83% +/- 0.14%
Internal CCS correction (all correction functions): Mean bias = -0.05%
+/- 0.33%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions

TG, [M+Na]
Number of lipids: 30
Correction done.
Number of lipids
taken for linear correction function: 3
Max. combinations: 4060
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.79% +/- 0.17%
Internal CCS correction (all correction functions): Mean bias = 0.01%
+/- 0.41%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 4
Max. combinations: 27405
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.79% +/- 0.17%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.39%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 5
Max. combinations: 142506
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.79% +/- 0.17%
Internal CCS correction (all correction functions): Mean bias = -0.03%
+/- 0.34%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

Number of lipids
taken for linear correction function: 6
Max. combinations: 593775
Numbers of iterations for resampling: 100
No duplicates found in the resampled lipid combinations.
Correction
functions
y = m * x + b
Input:
x = Measured CCS of U
13C labeled lipid
y =
DTCCS
N2 of U
13C labeled lipid
CCS bias
No CCS correction: Mean bias = 0.79% +/- 0.17%
Internal CCS correction (all correction functions): Mean bias = -0.06%
+/- 0.32%
CCS bias for each correction fuction:
Violin plot -
CCS bias: No CCS correction vs. internal CCS correction

Violin plot -
CCS bias distribution for each internal CCS correction function

CCS bias: All
correction functions
